2-[4-chloranyl-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-5-nitro-hexan-1-ol

Systemtic Name: 2-[4-chloranyl-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-5-nitro-hexan-1-ol Openeye Name: 2-[4-chloro-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-5-nitro-hexan-1-ol CAS Name: 2-[[4-chloro-1-methyl-5-(trifluoromethyl)-3-pyrazolyl]oxy]-5-nitro-1-hexanol IUPAC Name: 2-[4-chloro-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-5-nitrohexan-1-ol Traditional Name: 2-[4-chloro-1-methyl-5-(trifluoromethyl)pyrazol-3-yl]oxy-5-nitro-hexan-1-ol Formula: C11H15ClF3N3O4 MolecularWeight: 345.70271

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(CO)OC1=NN(C(=C1Cl)C(F)(F)F)C)[N+](=O)[O-]

Isomeric SMILES

CC(CCC(CO)OC1=NN(C(=C1Cl)C(F)(F)F)C)[N+](=O)[O-]

InChI

InChI=1S/C11H15ClF3N3O4/c1-6(18(20)21)3-4-7(5-19)22-10-8(12)9(11(13,14)15)17(2)16-10/h6-7,19H,3-5H2,1-2H3